Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR5A1 | Q13285 | 1/20 | 0.49 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | UGCG | Q16739 | 4/20 | 0.41 |
| ▸ | GBA2 | Q9HCG7 | 4/20 | 0.41 |
| ▸ | GBA1 | P04062 | 3/20 | 0.41 |
| ▸ | LCT | P09848 | 3/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.41 |
| ▸ | SI | P14410 | 2/20 | 0.41 |
| ▸ | RARB | P10826 | 3/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9547799 | 0.98 | NR5A1 (0.51) | NR5A1LTA4HESR1LMNAUGCG | |
| SCHEMBL9547831 | 0.98 | NR5A1 (0.51) | NR5A1LTA4HESR1LMNAUGCG | |
| SCHEMBL9547755 | 0.93 | NR5A1 (0.56) | NR5A1LTA4HESR1LMNACYP1A2 | |
| SCHEMBL9547785 | 0.93 | NR5A1 (0.56) | NR5A1LTA4HESR1LMNACYP1A2 | |
| SCHEMBL9761610 | 0.93 | NR5A1 (0.56) | NR5A1LTA4HESR1LMNACYP1A2 | |
| SCHEMBL9547839 | 0.88 | ESR1 (0.42) | LTA4HESR1LMNACYP1A2CYP2D6 | |
| SCHEMBL9547860 | 0.83 | ESR1 (0.47) | NR5A1LTA4HESR1LMNACYP1A2 | |
| SCHEMBL9331239 | 0.82 | RARB (0.65) | TSHRRARBALDH1A1TP53 | |
| SCHEMBL9330512 | 0.82 | RARB (0.65) | TSHRRARBALDH1A1TP53 | |
| SCHEMBL9328575 | 0.82 | RARB (0.65) | TSHRRARBALDH1A1TP53 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288297-B1 | OPTICALLY ACTIVE BENZENE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-03-17 | — | — | EP | disclosed |
| US-4985590-A | Optically active benzene derivatives and process for preparation thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-01-15 | — | — | US | disclosed |